ditert-butyl (5E)-5-(2-methoxy-2-oxidanylidene-1-phenylmethoxy-ethylidene)-1-oxidanylidene-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate

Systemtic Name: ditert-butyl (5E)-5-(2-methoxy-2-oxidanylidene-1-phenylmethoxy-ethylidene)-1-oxidanylidene-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate Openeye Name: ditert-butyl (5E)-5-(1-benzyloxy-2-methoxy-2-oxo-ethylidene)-1-oxo-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate CAS Name: (5E)-5-(2-methoxy-2-oxo-1-phenylmethoxyethylidene)-1-oxo-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (5E)-5-(2-methoxy-2-oxo-1-phenylmethoxyethylidene)-1-oxo-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate Traditional Name: (5E)-5-(1-benzoxy-2-keto-2-methoxy-ethylidene)-1-keto-3,4-dihydroazepin[3,4-b]indole-2,10-dicarboxylic acid ditert-butyl ester Formula: C32H36N2O8 MolecularWeight: 576.63684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(=C(C(=O)OC)OCC2=CC=CC=C2)C3=C(C1=O)N(C4=CC=CC=C43)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CC/C(=C(/C(=O)OC)\OCC2=CC=CC=C2)/C3=C(C1=O)N(C4=CC=CC=C43)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H36N2O8/c1-31(2,3)41-29(37)33-18-17-22(26(28(36)39-7)40-19-20-13-9-8-10-14-20)24-21-15-11-12-16-23(21)34(25(24)27(33)35)30(38)42-32(4,5)6/h8-16H,17-19H2,1-7H3/b26-22+